17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate
TL;DR: 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate (CAS 101831-46-3) is a chemical compound with molecular formula C21H28O4 and molecular weight 344.19876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(8R,9S,10R,13S,14S,17S)-17-hydroxy-10-methyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-13-yl]methyl acetate
Also Known As: 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate, 17-Hydroxy-3-oxoandrosta-1,4-dien-18-yl acetate, 17beta-Hydroxy-3-oxoandrosta-1,4-dien-18-yl acetate, ANDROSTA-1,4-DIEN-3-ONE, 17-beta,19-DIHYDROXY-, 19-ACETATE, 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one19-acetate
Technical Specifications
| Molecular Formula | C21H28O4 |
| Molecular Weight | 344.19876 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.19876 Da |
| Heavy Atoms | 25 |
| Complexity | 663.0 |
| SMILES | CC(=O)OC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)C=C[C@]34C |
| InChIKey | FDUNNLDIGLEHFE-SJFWLOONSA-N |
Chemical Property Profile of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate
Property Insights of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate. Following Lipinski's Rule of Five, 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate?
The CAS number of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate is 101831-46-3.
What is the molecular formula of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate?
The molecular formula of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate is C21H28O4.
What is the molecular weight of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate?
The molecular weight of 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate is 344.19876 g/mol.
Where can I buy 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate?
You can request a quote for 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate?
Yes, CoreyChem provides custom synthesis services for 17-beta,19-Dihydroxyandrosta-1,4-dien-3-one 19-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.